| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 2009 | 20 | Yes |
Popular Name: N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]pyridin-3-amine N-[(6-chloro-3,4-dihydro-2H-1,5-…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 2.71 | 5.82 | -7.9 | 1 | 4 | 0 | 43 | 290.75 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.71 | 6.28 | -37.19 | 2 | 4 | 1 | 45 | 291.758 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
